Geometry & MOs

Info

ID:	226197
PubChem CID:	87349956
Reduced:	SnCl2C4H6 (1)
Stoich.:	AB2C4D6 (1)
Weight, g/mol:	477.152241
ΔH_f, kcal/mol:	-26.11
Dipole, Da:	3.44
IP(EA), eV:	-8.96(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[5-[4-[(2-fluorophenyl)carbamothioylamino]phenyl]-3-oxo-1H-isoindol-2-yl]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

C=CC=C.Cl[Sn]Cl

DOS

IR

Vibrations